LE0GU3 -OEChem-05022323263D 42 46 0 0 0 0 0 0 0999 V2000 -5.4236 1.6813 -0.0027 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5668 3.0430 -0.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6195 1.8068 -1.1641 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6245 0.9555 -0.3909 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3714 2.3571 1.2858 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3298 -1.6866 0.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6714 0.2300 1.3651 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3293 -2.5712 0.3216 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -3.1097 -1.0022 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0387 2.8070 -1.2289 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4038 -4.5162 -1.0779 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3475 -0.5752 1.2939 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6021 -0.3724 2.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9009 -1.1525 -0.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7381 -2.0141 -0.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8246 -0.0359 0.5745 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6988 0.1808 1.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9185 0.8305 0.6527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0624 0.5922 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0441 -1.3895 -1.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 1.4076 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1247 -0.5131 -0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5587 1.8759 -0.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8963 -0.5405 1.0682 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7307 1.1700 -0.3539 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9308 -0.0433 0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -3.4101 -0.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8758 2.9927 -1.5107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4028 0.3387 2.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8972 -1.3109 2.5655 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8625 1.6936 1.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1057 -2.2450 -1.7223 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6092 1.9832 0.6824 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0056 -0.7072 -1.5679 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0326 -1.4941 1.5723 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8557 -0.5962 0.1536 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4454 3.8714 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7613 3.0293 -2.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7494 3.7488 -0.9379 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6066 2.7926 -2.0849 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3399 -4.7939 -0.8007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9503 -5.1189 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 19 1 0 0 0 0 2 23 1 0 0 0 0 2 28 1 0 0 0 0 3 25 1 0 0 0 0 3 28 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 7 12 2 0 0 0 0 7 16 1 0 0 0 0 8 27 2 0 0 0 0 9 15 2 0 0 0 0 9 27 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 27 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 17 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 14 20 1 0 0 0 0 16 18 1 0 0 0 0 17 21 2 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 22 1 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 23 25 2 0 0 0 0 24 26 2 0 0 0 0 24 35 1 0 0 0 0 25 26 1 0 0 0 0 26 36 1 0 0 0 0 28 37 1 0 0 0 0 28 38 1 0 0 0 0 M END $$$$